2-[4-(2-fluoranyl-4-heptyl-phenyl)phenyl]-5-hexyl-pyrimidine

Systemtic Name: 2-[4-(2-fluoranyl-4-heptyl-phenyl)phenyl]-5-hexyl-pyrimidine Openeye Name: 2-[4-(2-fluoro-4-heptyl-phenyl)phenyl]-5-hexyl-pyrimidine CAS Name: 2-[4-(2-fluoro-4-heptylphenyl)phenyl]-5-hexylpyrimidine IUPAC Name: 2-[4-(2-fluoro-4-heptylphenyl)phenyl]-5-hexylpyrimidine Traditional Name: 2-[4-(2-fluoro-4-heptyl-phenyl)phenyl]-5-hexyl-pyrimidine Formula: C29H37FN2 MolecularWeight: 432.615883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)CCCCCC)F

Isomeric SMILES

CCCCCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)CCCCCC)F

InChI

InChI=1S/C29H37FN2/c1-3-5-7-9-11-12-23-14-19-27(28(30)20-23)25-15-17-26(18-16-25)29-31-21-24(22-32-29)13-10-8-6-4-2/h14-22H,3-13H2,1-2H3